#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/40/1534001.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1534001 loop_ _publ_author_name 'Pecharsky, A.O.' 'Mozharivsky, Yu.' 'Dennis, K.W.' 'Miller, G.J.' 'McCallum, R.W.' 'Pecharskii, V.K.' 'Gschneidner, K.A.jr.' _publ_section_title ; Preparation, crystal structure, heat capacity, magnetism and the magnetocaloric effect of Pr5 Ni1.9 Si3 and Pr Ni ; _journal_name_full 'Physical Review, Serie 3. B - Condensed Matter (18,1978-)' _journal_page_first 134452-1 _journal_page_last 134452-8 _journal_volume 68 _journal_year 2003 _chemical_formula_sum 'Ni Pr' _chemical_name_systematic 'Pr Ni' _space_group_IT_number 63 _symmetry_space_group_name_Hall '-C 2c 2' _symmetry_space_group_name_H-M 'C m c m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 3.8307 _cell_length_b 10.543 _cell_length_c 4.369 _cell_volume 176.451 _citation_journal_id_ASTM PRBMDO _cod_data_source_file Pecharsky_PRBMDO_2003_1973.cif _cod_data_source_block Ni1Pr1 _cod_original_cell_volume 176.4511 _cod_original_formula_sum 'Ni1 Pr1' _cod_database_code 1534001 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,z+1/2 x,-y,-z -x,y,-z+1/2 -x,-y,-z x,y,-z-1/2 -x,y,z x,-y,z-1/2 x+1/2,y+1/2,z -x+1/2,-y+1/2,z+1/2 x+1/2,-y+1/2,-z -x+1/2,y+1/2,-z+1/2 -x+1/2,-y+1/2,-z x+1/2,y+1/2,-z-1/2 -x+1/2,y+1/2,z x+1/2,-y+1/2,z-1/2 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv Ni1 Ni 0 0.0724 0.75 1 0.0 Pr1 Pr 0 0.36178 0.75 1 0.0